Chemical Properties of Benzamide, 2-chloro-n-cyanomethyl-4-nitro-n-phenyl-

Benzamide, 2-chloro-n-cyanomethyl-4-nitro-n-phenyl-

InChI
InChI=1S/C15H10ClN3O3/c16-14-10-12(19(21)22)6-7-13(14)15(20)18(9-8-17)11-4-2-1-3-5-11/h1-7,10H,9H2
InChI Key
GOAPRVVYNWEGBW-UHFFFAOYSA-N
Formula
C15H10ClN3O3
SMILES
N#CCN(C(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1
Molecular Weight1
315.72
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Physical Properties

Property Value Unit Source
ΔfusH° 43.59 kJ/mol Joback Calculated Property
log10WS -5.29 Relay (1.0) Calculated Property
logPoct/wat 3.419 Crippen Calculated Property
McVol 217.280 ml/mol McGowan Calculated Property
Tfus 418.30 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [601.18; 640.86] J/mol×K [963.78; 1229.87] Show Hide
Cp,gas 601.18 J/mol×K 963.78 Joback Calculated Property
Cp,gas 609.56 J/mol×K 1008.13 Joback Calculated Property
Cp,gas 617.08 J/mol×K 1052.48 Joback Calculated Property
Cp,gas 623.86 J/mol×K 1096.82 Joback Calculated Property
Cp,gas 630.00 J/mol×K 1141.17 Joback Calculated Property
Cp,gas 635.63 J/mol×K 1185.52 Joback Calculated Property
Cp,gas 640.86 J/mol×K 1229.87 Joback Calculated Property

Similar Compounds

Benzamide, N-ethyl-N-(3-methylphenyl)-4-chloro-. 1-Naphthamide, N-ethyl-N-(3-methylphenyl)-. Galathan, 1,2,3,12,15,16-hexadehydro-9,10-[methylenebis(oxy)]-. Norhydrocodone. Metergoline. Bialophos, N,O,O-tris(tert-butyldimethylsilyl)deriv.. Benzamide, N-ethyl-N-(3-methylphenyl)-4-ethyl-. Hydrocodone. DIHYDROMORPHINE. Naloxone, bis(trimethylsilyl) ether. Oxycodone, trimethylsilyl ether. Naltrexone. Morphinan-6-ol, 4,5-epoxy-3-methoxy-17-methyl-, (5«alpha»,6«alpha»)-. (2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane. Hydromorphone.

Find more compounds similar to Benzamide, 2-chloro-n-cyanomethyl-4-nitro-n-phenyl-.

Sources

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